Geometry & MOs

Info

ID:	241433
PubChem CID:	96023403
Reduced:	FN2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	273.116507
ΔH_f, kcal/mol:	-151.43
Dipole, Da:	2.92
IP(EA), eV:	-8.87(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-8-fluoro-1-[(4-hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-7-ol

Drug info:

PubChemData

Smile

CN(C[C@H]1C2=CC(=C(C=C2CCN1)F)O)CC(=O)O

DOS

IR

Vibrations